Information card for entry 1550727

Structure parameters

• Formula: C36 H24 N2 O2 S
• Calculated formula: C36 H24 N2 O2 S
• SMILES: S(=O)(=O)(c1ccccc1n1c2ccccc2c2ccccc12)c1ccccc1n1c2ccccc2c2ccccc12
• Title of publication: Intramolecular electronic coupling for persistent room-temperature luminescence for smartphone based time-gated fingerprint detection
• Authors of publication: Tian, Di; Zhu, Zece; Xu, Li; Cong, Hengjiang; Zhu, Jintao
• Journal of publication: Materials Horizons
• Year of publication: 2019
• Journal volume: 6
• Journal issue: 6
• Pages of publication: 1215
• a: 10.9667 ± 0.0005 Å
• b: 12.303 ± 0.0005 Å
• c: 20.3131 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2740.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0663
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0884
• Weighted residual factors for all reflections included in the refinement: 0.102
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No